6-azanyl-2-[(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[(1S)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[(1S)-2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl]thio]-1H-pyrimidin-4-one Formula: C20H16N4O2S MolecularWeight: 376.43164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)SC4=NC(=O)C=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)C2=CNC3=CC=CC=C32)SC4=NC(=O)C=C(N4)N

InChI

InChI=1S/C20H16N4O2S/c21-16-10-17(25)24-20(23-16)27-19(12-6-2-1-3-7-12)18(26)14-11-22-15-9-5-4-8-13(14)15/h1-11,19,22H,(H3,21,23,24,25)/t19-/m0/s1